6XRR

Structure of SciW bound to the Rhs1 Transmembrane Domain from Salmonella typhimurium

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08ID-1
Synchrotron site	CLSI
Beamline	08ID-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-12-05
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.97895
Spacegroup name	P 31 2 1
Unit cell lengths	105.306, 105.306, 248.364
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	91.200 - 1.900
R-factor	0.1877
Rwork	0.186
R-free	0.21330
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	SciW
RMSD bond length	0.004
RMSD bond angle	0.680
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	91.200	2.000
High resolution limit [Å]	1.900	1.900
Rmerge	0.057	0.346
Number of reflections	126623	12473
<I/σ(I)>	11.6	1.26
Completeness [%]	99.9	99.6
Redundancy	9.9
CC(1/2)	0.999	0.539

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	277	25mg/mL protein, 0.2M Ammonium sulfate, 0.1M Bis-TRIS pH 5.5, 25% (w/v) PEG 3350